N-cyclohexyl-2-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-cyclohexyl-2-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(E)-(4-benzyloxy-3-iodo-5-methoxy-phenyl)methyleneamino]-N-cyclohexyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-cyclohexyl-2-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-cyclohexyl-2-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(E)-(4-benzoxy-3-iodo-5-methoxy-benzylidene)amino]-N-cyclohexyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C30H33IN2O3S MolecularWeight: 628.56409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)NC4CCCCC4)I)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/C2=C(C3=C(S2)CCCC3)C(=O)NC4CCCCC4)I)OCC5=CC=CC=C5

InChI

InChI=1S/C30H33IN2O3S/c1-35-25-17-21(16-24(31)28(25)36-19-20-10-4-2-5-11-20)18-32-30-27(23-14-8-9-15-26(23)37-30)29(34)33-22-12-6-3-7-13-22/h2,4-5,10-11,16-18,22H,3,6-9,12-15,19H2,1H3,(H,33,34)/b32-18+